9-[(2Z,4Z)-hexa-2,4-dienyl]carbazole

C18H17N — CID 89011287

IUPAC9-[(2Z,4Z)-hexa-2,4-dienyl]carbazole
SMILESC/C=C\C=C/Cn1c2ccccc2c2ccccc21
InChIInChI=1S/C18H17N/c1-2-3-4-9-14-19-17-12-7-5-10-15(17)16-11-6-8-13-18(16)19/h2-13H,14H2,1H3/b3-2-,9-4-
InChIKeyWNBQCRWFICNGOU-UARZHTBLSA-N
MW247.34 g/mol
LogP4.93
Rot. Bonds3

About 9-[(2Z,4Z)-hexa-2,4-dienyl]carbazole

9-[(2Z,4Z)-hexa-2,4-dienyl]carbazole (PubChem CID 89011287) has the molecular formula C18H17N and a molecular weight of 247.34 g/mol. Its IUPAC name is 9-[(2Z,4Z)-hexa-2,4-dienyl]carbazole.

Molecular Properties

Compound Name9-[(2Z,4Z)-hexa-2,4-dienyl]carbazole
PubChem CID89011287
Molecular FormulaC18H17N
Molecular Weight247.34 g/mol
Exact Mass247.14
IUPAC Name9-[(2Z,4Z)-hexa-2,4-dienyl]carbazole
SMILESC/C=C\C=C/Cn1c2ccccc2c2ccccc21
InChIInChI=1S/C18H17N/c1-2-3-4-9-14-19-17-12-7-5-10-15(17)16-11-6-8-13-18(16)19/h2-13H,14H2,1H3/b3-2-,9-4-
InChIKeyWNBQCRWFICNGOU-UARZHTBLSA-N
XLogP4.93
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 54.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'polyene', 'substructure': 'N/A'}

Analyze 9-[(2Z,4Z)-hexa-2,4-dienyl]carbazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N,N-Dimethyltryptamine
CID 6089
Carbazole
CID 6854
Pyrvinium
CID 5281035
Latrepirdine
CID 197033
Iprindole
CID 21722
N,N-Diethyltryptamine
CID 6090
Rimcazole
CID 53389
Mebhydrolin
CID 22530
LE-300
CID 4350931
2,3-Dimethylindole
CID 7053
2-Phenylindole
CID 13698
3-Amino-9-ethylcarbazole
CID 8588

Frequently Asked Questions

What is the IUPAC name of 9-[(2Z,4Z)-hexa-2,4-dienyl]carbazole?
The IUPAC name of 9-[(2Z,4Z)-hexa-2,4-dienyl]carbazole (CID 89011287) is 9-[(2Z,4Z)-hexa-2,4-dienyl]carbazole.
What is the SMILES notation for 9-[(2Z,4Z)-hexa-2,4-dienyl]carbazole?
The canonical SMILES for 9-[(2Z,4Z)-hexa-2,4-dienyl]carbazole is C/C=C\C=C/Cn1c2ccccc2c2ccccc21.
What is the InChIKey of 9-[(2Z,4Z)-hexa-2,4-dienyl]carbazole?
The InChIKey is WNBQCRWFICNGOU-UARZHTBLSA-N. The full InChI is InChI=1S/C18H17N/c1-2-3-4-9-14-19-17-12-7-5-10-15(17)16-11-6-8-13-18(16)19/h2-13H,14H2,1H3/b3-2-,9-4-.
What are the key properties of 9-[(2Z,4Z)-hexa-2,4-dienyl]carbazole?
9-[(2Z,4Z)-hexa-2,4-dienyl]carbazole has a molecular weight of 247.34 g/mol, XLogP of 4.93, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[(2Z,4Z)-hexa-2,4-dienyl]carbazole is sourced from PubChem (CID 89011287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).